9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene

C251H182 — CID 160962902

IUPAC9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene
SMILESCC1(C)c2cc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)ccc2-c2ccc3ccccc3c21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)c3)cc21
InChIInChI=1S/2C45H32.C44H34.3C39H28/c1-45(2)41-24-10-9-18-34(41)35-26-25-31(28-42(35)45)30-15-11-16-32(27-30)43-37-19-5-7-21-39(37)44(40-22-8-6-20-38(40)43)36-23-12-14-29-13-3-4-17-33(29)36;1-45(2)41-21-10-9-15-34(41)35-27-26-32(28-42(35)45)29-22-24-31(25-23-29)43-37-16-5-7-18-39(37)44(40-19-8-6-17-38(40)43)36-20-11-13-30-12-3-4-14-33(30)36;1-43(2)37-19-11-9-13-29(37)31-23-21-27(25-39(31)43)41-33-15-5-7-17-35(33)42(36-18-8-6-16-34(36)41)28-22-24-32-30-14-10-12-20-38(30)44(3,4)40(32)26-28;1-39(2)35-21-10-9-15-28(35)29-23-22-26(24-36(29)39)37-31-16-5-7-18-33(31)38(34-19-8-6-17-32(34)37)30-20-11-13-25-12-3-4-14-27(25)30;1-39(2)35-18-10-9-13-29(35)30-22-21-28(24-36(30)39)38-33-16-7-5-14-31(33)37(32-15-6-8-17-34(32)38)27-20-19-25-11-3-4-12-26(25)23-27;1-39(2)35-24-27(21-22-29(35)34-23-20-25-12-6-7-15-28(25)38(34)39)37-32-18-10-8-16-30(32)36(26-13-4-3-5-14-26)31-17-9-11-19-33(31)37/h2*3-28H,1-2H3;5-26H,1-4H3;3*3-24H,1-2H3
InChIKeySXFSXVZIHAGUTJ-UHFFFAOYSA-N
MW3198.22 g/mol
LogP69.21
Rot. Bonds14

About 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene

9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene (PubChem CID 160962902) has the molecular formula C251H182 and a molecular weight of 3198.22 g/mol. Its IUPAC name is 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene.

Molecular Properties

Compound Name9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene
PubChem CID160962902
Molecular FormulaC251H182
Molecular Weight3198.22 g/mol
Exact Mass3195.42
IUPAC Name9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene
SMILESCC1(C)c2cc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)ccc2-c2ccc3ccccc3c21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)c3)cc21
InChIInChI=1S/2C45H32.C44H34.3C39H28/c1-45(2)41-24-10-9-18-34(41)35-26-25-31(28-42(35)45)30-15-11-16-32(27-30)43-37-19-5-7-21-39(37)44(40-22-8-6-20-38(40)43)36-23-12-14-29-13-3-4-17-33(29)36;1-45(2)41-21-10-9-15-34(41)35-27-26-32(28-42(35)45)29-22-24-31(25-23-29)43-37-16-5-7-18-39(37)44(40-19-8-6-17-38(40)43)36-20-11-13-30-12-3-4-14-33(30)36;1-43(2)37-19-11-9-13-29(37)31-23-21-27(25-39(31)43)41-33-15-5-7-17-35(33)42(36-18-8-6-16-34(36)41)28-22-24-32-30-14-10-12-20-38(30)44(3,4)40(32)26-28;1-39(2)35-21-10-9-15-28(35)29-23-22-26(24-36(29)39)37-31-16-5-7-18-33(31)38(34-19-8-6-17-32(34)37)30-20-11-13-25-12-3-4-14-27(25)30;1-39(2)35-18-10-9-13-29(35)30-22-21-28(24-36(30)39)38-33-16-7-5-14-31(33)37(32-15-6-8-17-34(32)38)27-20-19-25-11-3-4-12-26(25)23-27;1-39(2)35-24-27(21-22-29(35)34-23-20-25-12-6-7-15-28(25)38(34)39)37-32-18-10-8-16-30(32)36(26-13-4-3-5-14-26)31-17-9-11-19-33(31)37/h2*3-28H,1-2H3;5-26H,1-4H3;3*3-24H,1-2H3
InChIKeySXFSXVZIHAGUTJ-UHFFFAOYSA-N
XLogP69.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms251
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003198.22
LogP ≤ 569.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene?
The IUPAC name of 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene (CID 160962902) is 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene.
What is the SMILES notation for 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene?
The canonical SMILES for 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene is CC1(C)c2cc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)ccc2-c2ccc3ccccc3c21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)c3)cc21.
What is the InChIKey of 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene?
The InChIKey is SXFSXVZIHAGUTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C45H32.C44H34.3C39H28/c1-45(2)41-24-10-9-18-34(41)35-26-25-31(28-42(35)45)30-15-11-16-32(27-30)43-37-19-5-7-21-39(37)44(40-22-8-6-20-38(40)43)36-23-12-14-29-13-3-4-17-33(29)36;1-45(2)41-21-10-9-15-34(41)35-27-26-32(28-42(35)45)29-22-24-31(25-23-29)43-37-16-5-7-18-39(37)44(40-19-8-6-17-38(40)43)36-20-11-13-30-12-3-4-14-33(30)36;1-43(2)37-19-11-9-13-29(37)31-23-21-27(25-39(31)43)41-33-15-5-7-17-35(33)42(36-18-8-6-16-34(36)41)28-22-24-32-30-14-10-12-20-38(30)44(3,4)40(32)26-28;1-39(2)35-21-10-9-15-28(35)29-23-22-26(24-36(29)39)37-31-16-5-7-18-33(31)38(34-19-8-6-17-32(34)37)30-20-11-13-25-12-3-4-14-27(25)30;1-39(2)35-18-10-9-13-29(35)30-22-21-28(24-36(30)39)38-33-16-7-5-14-31(33)37(32-15-6-8-17-34(32)38)27-20-19-25-11-3-4-12-26(25)23-27;1-39(2)35-24-27(21-22-29(35)34-23-20-25-12-6-7-15-28(25)38(34)39)37-32-18-10-8-16-30(32)36(26-13-4-3-5-14-26)31-17-9-11-19-33(31)37/h2*3-28H,1-2H3;5-26H,1-4H3;3*3-24H,1-2H3.
What are the key properties of 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene?
9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene has a molecular weight of 3198.22 g/mol, XLogP of 69.21, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-bis(9,9-dimethylfluoren-2-yl)anthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-1-ylanthracene;9-(9,9-dimethylfluoren-2-yl)-10-naphthalen-2-ylanthracene;9-[3-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;9-[4-(9,9-dimethylfluoren-2-yl)phenyl]-10-naphthalen-1-ylanthracene;11,11-dimethyl-9-(10-phenylanthracen-9-yl)benzo[a]fluorene is sourced from PubChem (CID 160962902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).